UCSF

ZINC04081988

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 21 No

Popular Name: 10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-dione 10,13-dimethyl-2,4,5,6,7,8,9,11,…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.24 9.4 -9.57 0 2 0 34 288.431 0 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0052799A1; EP0160434A1; EP0261614A2; EP0269786A1; EP0269786B1; EP0326340A2; EP0326340B1; EP0528906B1; EP0531026B1; EP0756481B1; EP0801557A2; EP0827401A2; US3300485; US4097334; US4110326; US4150126; US4361578; US4397947; US4507242; US4889801; US4970327 IBM Patent Data

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )